UCSF

ZINC33736966

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 28 No

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Annotations

None

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.87 7.67 -48.49 0 5 -1 64 455.364 7
Lo Low (pH 4.5-6) 4.41 9.5 -17.16 1 5 0 61 456.372 7

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )